3,5-Dibromobenzoic acid (618-58-6) is also named as Benzoic acid, 3,5-dibromo- ; Rarechem AL BO 0773;3,5-Dibromobenzoic acid ; BUTTPARK 99\57-19 ; 411523_ALDRICH ; 33960_FLUKA ; BRN 1940691 ; CID12063 ; CD11016 ; LS-36758 ,and so on.3,5-Dibromobenzoic acid (618-58-6) is white to light yellow crystal powder.
IUPAC Name: 3,5-dibromobenzoic acid
CAS: 618-58-6
Molecular Formula: C7H4Br2O2
Molecular Weight: 279.91
Melting point: 218-220 °C(lit.)
Molecular structure:
ACD/LogD (pH 5.5): 1.43
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 5.5): 2.34
ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 16.75
ACD/KOC (pH 7.4): 1.52
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 1
Index of Refraction: 1.642
Molar Refractivity: 48.56 cm3
Molar Volume: 134.3 cm3
Polarizability: 19.25 10-24cm3
Surface Tension: 57.7 dyne/cm
Density: 2.083 g/cm3
Flash Point: 168.6 °C
Enthalpy of Vaporization: 63.35 kJ/mol
Boiling Point: 355.2 °C at 760 mmHg
Vapour Pressure: 1.17E-05 mmHg at 25°C
3,5-Dibromobenzoic acid (618-58-6) is commonly used as pharmaceutical intermediate and pesticide intermediate.
RTECS: DG6290010
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 562mg/kg (562mg/kg) | BEHAVIORAL: REGIDITY BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) | Journal of Medicinal Chemistry. Vol. 11, Pg. 1020, 1968. |
Hazard Codes: Xi
Risk Statements: 36/37/38 (36/37/38: Irritating to eyes, respiratory system and skin)
Safety Statements: 26-37/39 (26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 37/39: Wear suitable gloves and eye/face protection)
WGK Germany: 3
Hazard Note: Irritant
Removal in wastewater treatment of 3,5-Dibromobenzoic acid (618-58-6) can be stated as follows:
Total removal:16.92 percent
Total biodegradation:0.21 percent
Total sludge adsorption:16.70 percent
Total to Air:0.00 percent
(using 10000 hr Bio P,A,S)
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